Vitas-M small molecule compound
2-oxo-2-(pyrrolidin-1-yl)ethyl 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Catalog ID
STL018460
SMILES CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)OCC(=O)N1CCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H31FN4O4 MW 470.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31FN4O4/c1-2-27-9-11-28(12-10-27)22-14-21-18(13-20(22)26)24(32)19(15-30(21)17-5-6-17)25(33)34-16-23(31)29-7-3-4-8-29/h13-15,17H,2-12,16H2,1H3InChIKey
OQUAGVPIBVOQEA-UHFFFAOYSA-NSynonyms
(2oxo2pyrrolidin1ylethyl)1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxoquinoline3carboxylate
2oxo2(pyrrolidin1yl)ethyl1cyclopropyl7(4ethylpiperazin1yl)6fluoro4oxo14dihydroquinoline3carboxylate
CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCC(=O)N4CCCC4)C5CC5)F
InChI=1SC25H31FN4O4c122791128(121027)22142118(1320(22)26)24(32)19(1530(21)175617)25(33)341623(31)29734829h131517H21216H21H3
MFCD18186961
ZINC000051364296
ZINC51364296
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